51186-58-4

Name Boc-D-aspartic acid 4-benzyl ester
CAS 51186-58-4
Molecular Formula C16H21NO6
MDL Number MFCD00038255
Molecular Weight 323.34
MOL File 51186-58-4.mol
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Chemical Properties

Boiling point  508.1±50.0 °C(Predicted)
density  1.219±0.06 g/cm3(Predicted)
storage temp.  Store at 0-5°C
solubility  Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
form  Powder
pka 3.65±0.23(Predicted)
color  White to off-white
BRN  2305471
Major Application peptide synthesis
InChI 1S/C16H21NO6/c1-16(2,3)23-15(21)17-12(14(19)20)9-13(18)22-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,19,20)/t12-/m1/s1
InChIKey SOHLZANWVLCPHK-GFCCVEGCSA-N
SMILES CC(C)(C)OC(=O)N[C@H](CC(=O)OCc1ccccc1)C(O)=O
CAS DataBase Reference 51186-58-4(CAS DataBase Reference)

Safety Data

WGK Germany  3
HazardClass  IRRITANT
HS Code  29224999
Storage Class 11 - Combustible Solids

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